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Substance Name: Adenosine, N-(2-(5-carboxy-1H-indol-3-yl)ethyl)-
ID: AU73572700
InChIKey: LPAKNTMOZHYAEJ-WVSUBDOOSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H22-N6-O5

Molecular Weight

  • 454.4408
 
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Names and Synonyms

Synonyms

  • N(sup 6)-(beta-(5-Carboxyindolyl-3)-ethyl)adenosine
  • N-(2-(5-Carboxy-1H-indol-3-yl)ethyl)adenosine

Systematic Name

  • Adenosine, N-(2-(5-carboxy-1H-indol-3-yl)ethyl)-

Registry Numbers

ID Number

  • NIOSH/AU7357270

System Generated Number

  • AU73572700

Structure Descriptors

InChI

1S/C21H22N6O6/c28-7-14-16(29)17(30)20(33-14)27-9-26-15-18(24-8-25-19(15)27)22-4-3-11-6-23-13-2-1-10(21(31)32)5-12(11)13/h1-2,5-6,8-9,14,16-17,20,23,28-30H,3-4,7H2,(H,31,32)(H,22,24,25)/t14-,16-,17-,20-/m1/s1

InChIKey

LPAKNTMOZHYAEJ-WVSUBDOOSA-N

Smiles

OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n2cnc3c(NCCc4c[nH]c5ccc(cc45)C(=O)O)ncnc23